N-cyclopentyl-2-[6-(furan-2-yl)pyridazin-3-yl]sulfanylacetamide

C15H17N3O2S — CID 7207106

IUPACN-cyclopentyl-2-[6-(furan-2-yl)pyridazin-3-yl]sulfanylacetamide
SMILESO=C(CSc1ccc(-c2ccco2)nn1)NC1CCCC1
InChIInChI=1S/C15H17N3O2S/c19-14(16-11-4-1-2-5-11)10-21-15-8-7-12(17-18-15)13-6-3-9-20-13/h3,6-9,11H,1-2,4-5,10H2,(H,16,19)
InChIKeyNDAJURCJZUVTDG-UHFFFAOYSA-N
MW303.39 g/mol
LogP2.89
Rot. Bonds5

About N-cyclopentyl-2-[6-(furan-2-yl)pyridazin-3-yl]sulfanylacetamide

N-cyclopentyl-2-[6-(furan-2-yl)pyridazin-3-yl]sulfanylacetamide (PubChem CID 7207106) has the molecular formula C15H17N3O2S and a molecular weight of 303.39 g/mol. Its IUPAC name is N-cyclopentyl-2-[6-(furan-2-yl)pyridazin-3-yl]sulfanylacetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[6-(furan-2-yl)pyridazin-3-yl]sulfanylacetamide
PubChem CID7207106
Molecular FormulaC15H17N3O2S
Molecular Weight303.39 g/mol
Exact Mass303.10
IUPAC NameN-cyclopentyl-2-[6-(furan-2-yl)pyridazin-3-yl]sulfanylacetamide
SMILESO=C(CSc1ccc(-c2ccco2)nn1)NC1CCCC1
InChIInChI=1S/C15H17N3O2S/c19-14(16-11-4-1-2-5-11)10-21-15-8-7-12(17-18-15)13-6-3-9-20-13/h3,6-9,11H,1-2,4-5,10H2,(H,16,19)
InChIKeyNDAJURCJZUVTDG-UHFFFAOYSA-N
XLogP2.89
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.39
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[6-(Furan-2-yl)pyridazin-3-yl]sulfanyl-1-pyrrolidin-1-ylethanone
CID 6624069
N-cyclohexyl-2-[6-(furan-2-yl)pyridazin-3-yl]sulfanylacetamide
CID 7207099
2-[6-(furan-2-yl)pyridazin-3-yl]sulfanyl-N-(4-methylphenyl)acetamide
CID 7207115
1-(Azepan-1-yl)-2-[6-(furan-2-yl)pyridazin-3-yl]sulfanylethanone
CID 7207196
3-(Furan-2-yl)-6-(methylsulfanyl)pyridazine
CID 6624109
N-Furan-2-ylmethyl-2-[6-(4-methoxy-phenyl)-pyridazin-3-ylsulfanyl]-acetamide
CID 644447
N-(furan-2-ylmethyl)-2-((6-phenylpyridazin-3-yl)thio)acetamide
CID 3228000
2-[6-(furan-2-yl)pyridazin-3-yl]sulfanyl-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 6624223
2-[6-(furan-2-yl)pyridazin-3-yl]sulfanyl-N-phenylacetamide
CID 7207110
N-(3,5-dimethylphenyl)-2-[6-(furan-2-yl)pyridazin-3-yl]sulfanylacetamide
CID 7207118
2-[6-(furan-2-yl)pyridazin-3-yl]sulfanyl-N-(2-methoxyphenyl)acetamide
CID 7207131
N-(2-ethoxyphenyl)-2-[6-(furan-2-yl)pyridazin-3-yl]sulfanylacetamide
CID 7207142

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[6-(furan-2-yl)pyridazin-3-yl]sulfanylacetamide?
The IUPAC name of N-cyclopentyl-2-[6-(furan-2-yl)pyridazin-3-yl]sulfanylacetamide (CID 7207106) is N-cyclopentyl-2-[6-(furan-2-yl)pyridazin-3-yl]sulfanylacetamide.
What is the SMILES notation for N-cyclopentyl-2-[6-(furan-2-yl)pyridazin-3-yl]sulfanylacetamide?
The canonical SMILES for N-cyclopentyl-2-[6-(furan-2-yl)pyridazin-3-yl]sulfanylacetamide is O=C(CSc1ccc(-c2ccco2)nn1)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-[6-(furan-2-yl)pyridazin-3-yl]sulfanylacetamide?
The InChIKey is NDAJURCJZUVTDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2S/c19-14(16-11-4-1-2-5-11)10-21-15-8-7-12(17-18-15)13-6-3-9-20-13/h3,6-9,11H,1-2,4-5,10H2,(H,16,19).
What are the key properties of N-cyclopentyl-2-[6-(furan-2-yl)pyridazin-3-yl]sulfanylacetamide?
N-cyclopentyl-2-[6-(furan-2-yl)pyridazin-3-yl]sulfanylacetamide has a molecular weight of 303.39 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[6-(furan-2-yl)pyridazin-3-yl]sulfanylacetamide is sourced from PubChem (CID 7207106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).